{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.399575 0.589511 ] [ 0.25 0.80292 0.613429 ] [ 0.75 0.096968 0.677101 ] [ 0.75 0.596968 0.822899 ] [ 0.75 0.100425 0.089511 ] [ 0.25 0.403032 0.177101 ] [ 0.25 0.30292 0.886571 ] [ 0.25 0.899575 0.910489 ] [ 0.25 0.903032 0.322899 ] [ 0.75 0.69708 0.113429 ] [ 0.75 0.600425 0.410489 ] [ 0.75 0.19708 0.386571 ] [ 0.25 0.601962 0.980362 ] [ 0.25 0.101962 0.519638 ] [ 0.75 0.898038 0.480362 ] [ 0.75 0.398038 0.019638 ] ] } "species" { "source-value" [ "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Rh" "Rh" "Rh" "Rh" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.33119195 "source-unit" "angstrom" } "b" { "source-value" 8.96464364 "source-unit" "angstrom" } "c" { "source-value" 11.54035686 "source-unit" "angstrom" } }